1-butyl-4-[(E)-2-naphthalen-1-ylethenyl]pyridin-1-ium bromide

Systemtic Name: 1-butyl-4-[(E)-2-naphthalen-1-ylethenyl]pyridin-1-ium bromide Openeye Name: 1-butyl-4-[(E)-2-(1-naphthyl)vinyl]pyridin-1-ium bromide CAS Name: 1-butyl-4-[(E)-2-(1-naphthalenyl)ethenyl]pyridin-1-ium bromide IUPAC Name: 1-butyl-4-[(E)-2-naphthalen-1-ylethenyl]pyridin-1-ium bromide Traditional Name: 1-butyl-4-[(E)-2-(1-naphthyl)vinyl]pyridin-1-ium bromide Formula: C21H22BrN MolecularWeight: 368.31008

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]1=CC=C(C=C1)C=CC2=CC=CC3=CC=CC=C32.[Br-]

Isomeric SMILES

CCCC[N+]1=CC=C(C=C1)/C=C/C2=CC=CC3=CC=CC=C32.[Br-]

InChI

InChI=1S/C21H22N.BrH/c1-2-3-15-22-16-13-18(14-17-22)11-12-20-9-6-8-19-7-4-5-10-21(19)20;/h4-14,16-17H,2-3,15H2,1H3;1H/q+1;/p-1/b12-11+;